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BDBM50331462 1-Trifluoromethyl-cyclobutanecarboxylic acid{3-[(6-fluoro-1,1-dioxo-1H-1lambda*6*-benzo[d]isothiazol-3-yl)-phenyl-amino]2,2dimethylpropyl}amide::CHEMBL1289530

SMILES: CC(C)(CNC(=O)C1(CCC1)C(F)(F)F)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1

InChI Key: InChIKey=QYICUUHLNRBIMS-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50331462   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50331462
PNG
(1-Trifluoromethyl-cyclobutanecarboxylic acid{3-[(6...)
Show SMILES CC(C)(CNC(=O)C1(CCC1)C(F)(F)F)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1 |t:18|
Show InChI InChI=1S/C24H25F4N3O3S/c1-22(2,14-29-21(32)23(11-6-12-23)24(26,27)28)15-31(17-7-4-3-5-8-17)20-18-10-9-16(25)13-19(18)35(33,34)30-20/h3-5,7-10,13H,6,11-12,14-15H2,1-2H3,(H,29,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 320n/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 ion channel expressed in CHO K1 cells


Bioorg Med Chem Lett 20: 6989-92 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.131
BindingDB Entry DOI: 10.7270/Q2HD7VW2
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (Human))
BDBM50331462
PNG
(1-Trifluoromethyl-cyclobutanecarboxylic acid{3-[(6...)
Show SMILES CC(C)(CNC(=O)C1(CCC1)C(F)(F)F)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1 |t:18|
Show InChI InChI=1S/C24H25F4N3O3S/c1-22(2,14-29-21(32)23(11-6-12-23)24(26,27)28)15-31(17-7-4-3-5-8-17)20-18-10-9-16(25)13-19(18)35(33,34)30-20/h3-5,7-10,13H,6,11-12,14-15H2,1-2H3,(H,29,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 90n/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.3 ion channel expressed in CGE22 cells


Bioorg Med Chem Lett 20: 6989-92 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.131
BindingDB Entry DOI: 10.7270/Q2HD7VW2
More data for this
Ligand-Target Pair